N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide

C16H19ClN4O2 — CID 124754090

IUPACN-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide
SMILESCc1cc([C@H]2CCCCN2CC(=O)Nc2ccc(Cl)cn2)no1
InChIInChI=1S/C16H19ClN4O2/c1-11-8-13(20-23-11)14-4-2-3-7-21(14)10-16(22)19-15-6-5-12(17)9-18-15/h5-6,8-9,14H,2-4,7,10H2,1H3,(H,18,19,22)/t14-/m1/s1
InChIKeyNGOXNFFBXRZYNB-CQSZACIVSA-N
MW334.81 g/mol
LogP3.20
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide

N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide (PubChem CID 124754090) has the molecular formula C16H19ClN4O2 and a molecular weight of 334.81 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide
PubChem CID124754090
Molecular FormulaC16H19ClN4O2
Molecular Weight334.81 g/mol
Exact Mass334.12
IUPAC NameN-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide
SMILESCc1cc([C@H]2CCCCN2CC(=O)Nc2ccc(Cl)cn2)no1
InChIInChI=1S/C16H19ClN4O2/c1-11-8-13(20-23-11)14-4-2-3-7-21(14)10-16(22)19-15-6-5-12(17)9-18-15/h5-6,8-9,14H,2-4,7,10H2,1H3,(H,18,19,22)/t14-/m1/s1
InChIKeyNGOXNFFBXRZYNB-CQSZACIVSA-N
XLogP3.20
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.81
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide (CID 124754090) is N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide is Cc1cc([C@H]2CCCCN2CC(=O)Nc2ccc(Cl)cn2)no1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
The InChIKey is NGOXNFFBXRZYNB-CQSZACIVSA-N. The full InChI is InChI=1S/C16H19ClN4O2/c1-11-8-13(20-23-11)14-4-2-3-7-21(14)10-16(22)19-15-6-5-12(17)9-18-15/h5-6,8-9,14H,2-4,7,10H2,1H3,(H,18,19,22)/t14-/m1/s1.
What are the key properties of N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide has a molecular weight of 334.81 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 124754090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).